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The RSE43 subset - Results for HF

All results were obtained with the def2-TZVPP and def2-QZVP basis sets and extrapolated to the CBS limit.
For each data point of the subset, the actual result in Eh and the
deviation from the reference value (Res. - Ref.; in kcal/mol) are given.
At the end of the table, mean (MD), mean absolute (MAD) and root mean square (RMSD) deviations are shown.
The results were published in: Goerigk, L.; Grimme, S. Phys. Chem. Chem. Phys. 2011, DOI: 10.1039/C0CP02984J.

HF HF-D3 HF-D3(BJ)
# Result Res. - Ref. Result Res. - Ref. Result Res. - Ref.
1 -21.57 -6.3675 -21.12 -5.9167 -21.65 -6.4517
2 -1.08 -2.9765 -0.50 -2.3991 0.44 -1.4581
3 7.03 0.2314 7.43 0.6311 7.61 0.8058
4 0.94 -6.0628 2.02 -4.9792 1.69 -5.3084
5 0.86 0.7573 1.58 1.4765 1.24 1.1355
6 2.07 0.6698 2.74 1.3400 2.46 1.0594
7 -1.40 1.8037 -0.84 2.3559 -0.93 2.2651
8 -0.40 0.8973 0.07 1.3682 -0.13 1.1704
9 -1.02 0.7826 -0.56 1.2408 -0.83 0.9731
10 -19.25 -1.7519 -18.92 -1.4186 -19.33 -1.8298
11 -11.54 -1.5408 -11.18 -1.1817 -11.56 -1.5591
12 -8.85 -0.2465 -8.63 -0.0302 -8.76 -0.1592
13 -5.18 1.1249 -4.75 1.5452 -5.06 1.2362
14 -4.94 1.3573 -4.52 1.7839 -4.87 1.4324
15 -5.32 1.2794 -4.85 1.7489 -5.22 1.3783
16 -5.38 1.0245 -4.92 1.4811 -5.25 1.1524
17 -2.20 0.7954 -1.65 1.3452 -1.82 1.1776
18 -1.61 2.2895 -1.45 2.4474 -1.64 2.2580
19 -8.35 3.6523 -8.04 3.9565 -8.35 3.6463
20 5.24 0.5363 5.61 0.9056 5.36 0.6638
21 -8.35 4.2474 -7.88 4.7174 -8.09 4.5077
22 -6.57 4.5251 -6.26 4.8421 -6.62 4.4772
23 -3.88 4.7236 -3.45 5.1512 -3.67 4.9324
24 -8.16 4.6365 -7.45 5.3509 -7.56 5.2429
25 -0.88 2.4226 -0.35 2.9524 -0.97 2.3348
26 -1.31 2.5877 -0.85 3.0509 -1.20 2.6985
27 -1.51 1.1945 -1.15 1.5522 -0.86 1.8358
28 -2.81 3.0871 -2.35 3.5543 -2.85 3.0525
29 -2.80 3.3979 -2.17 4.0296 -2.77 3.4278
30 -2.88 1.3172 -2.68 1.5171 -2.76 1.4428
31 0.85 0.1456 1.03 0.3315 1.35 0.6472
32 -6.68 4.1163 -6.38 4.4195 -6.75 4.0451
33 -4.51 3.8854 -4.14 4.2555 -4.52 3.8787
34 3.45 0.7547 3.75 1.0457 3.62 0.9238
35 -5.88 3.5245 -5.65 3.7498 -5.92 3.4847
36 1.29 1.2928 1.91 1.9146 1.64 1.6369
37 -1.59 1.3142 -1.03 1.8741 -1.08 1.8184
38 -18.27 4.2329 -17.75 4.7451 -18.15 4.3480
39 -17.51 6.5918 -16.79 7.3103 -17.38 6.7210
40 -18.41 6.9876 -17.66 7.7422 -18.30 7.0957
41 -12.92 0.1817 -12.70 0.3960 -12.89 0.2071
42 -5.03 1.3740 -3.63 2.7692 -3.91 2.4905
43 -1.74 0.5561 -0.95 1.3488 -1.16 1.1419
MD 1.52 2.01 1.77
MAD 2.40 2.75 2.55
RMSD 3.06 3.33 3.12